5-methyl-4-[(2E)-2-[2-oxidanylidene-4-(trioxidanylsulfanyl)naphthalen-1-ylidene]hydrazinyl]-2-phenyl-1H-pyrazol-3-one

Systemtic Name: 5-methyl-4-[(2E)-2-[2-oxidanylidene-4-(trioxidanylsulfanyl)naphthalen-1-ylidene]hydrazinyl]-2-phenyl-1H-pyrazol-3-one Openeye Name: 5-methyl-4-[(2E)-2-[2-oxo-4-(trioxidanylsulfanyl)-1-naphthylidene]hydrazino]-2-phenyl-1H-pyrazol-3-one CAS Name: (4E)-4-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)hydrazinylidene]-3-oxo-1-naphthalenesulfenic acid hydroperoxy ester IUPAC Name: 5-methyl-4-[(2E)-2-[2-oxo-4-(trioxidanylsulfanyl)naphthalen-1-ylidene]hydrazinyl]-2-phenyl-1H-pyrazol-3-one Traditional Name: 4-[(N'E)-N'-[2-keto-4-(trioxidanylthio)-1-naphthylidene]hydrazino]-5-methyl-2-phenyl-3-pyrazolin-3-one Formula: C20H16N4O5S MolecularWeight: 424.42984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC=CC=C2)NN=C3C4=CC=CC=C4C(=CC3=O)SOOO

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC=CC=C2)N/N=C/3\C4=CC=CC=C4C(=CC3=O)SOOO

InChI

InChI=1S/C20H16N4O5S/c1-12-18(20(26)24(23-12)13-7-3-2-4-8-13)21-22-19-15-10-6-5-9-14(15)17(11-16(19)25)30-29-28-27/h2-11,21,23,27H,1H3/b22-19+